3-fluoranyl-N-[4-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)amino]phenyl]benzamide

Systemtic Name: 3-fluoranyl-N-[4-[(4-methyl-6-morpholin-4-yl-pyrimidin-2-yl)amino]phenyl]benzamide Openeye Name: 3-fluoro-N-[4-[(4-methyl-6-morpholino-pyrimidin-2-yl)amino]phenyl]benzamide CAS Name: 3-fluoro-N-[4-[[4-methyl-6-(4-morpholinyl)-2-pyrimidinyl]amino]phenyl]benzamide IUPAC Name: 3-fluoro-N-[4-[(4-methyl-6-morpholin-4-ylpyrimidin-2-yl)amino]phenyl]benzamide Traditional Name: 3-fluoro-N-[4-[(4-methyl-6-morpholino-pyrimidin-2-yl)amino]phenyl]benzamide Formula: C22H22FN5O2 MolecularWeight: 407.440783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)F)N4CCOCC4

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)F)N4CCOCC4

InChI

InChI=1S/C22H22FN5O2/c1-15-13-20(28-9-11-30-12-10-28)27-22(24-15)26-19-7-5-18(6-8-19)25-21(29)16-3-2-4-17(23)14-16/h2-8,13-14H,9-12H2,1H3,(H,25,29)(H,24,26,27)